4-(2-fluorophenyl)sulfonyl-N-(1,3-thiazol-2-yl)piperazine-1-carboxamide

C14H15FN4O3S2 — CID 134052883

IUPAC4-(2-fluorophenyl)sulfonyl-N-(1,3-thiazol-2-yl)piperazine-1-carboxamide
SMILESO=C(Nc1nccs1)N1CCN(S(=O)(=O)c2ccccc2F)CC1
InChIInChI=1S/C14H15FN4O3S2/c15-11-3-1-2-4-12(11)24(21,22)19-8-6-18(7-9-19)14(20)17-13-16-5-10-23-13/h1-5,10H,6-9H2,(H,16,17,20)
InChIKeyCWCIQFOFZXWKHQ-UHFFFAOYSA-N
MW370.43 g/mol
LogP1.82
Rot. Bonds3

About 4-(2-fluorophenyl)sulfonyl-N-(1,3-thiazol-2-yl)piperazine-1-carboxamide

4-(2-fluorophenyl)sulfonyl-N-(1,3-thiazol-2-yl)piperazine-1-carboxamide (PubChem CID 134052883) has the molecular formula C14H15FN4O3S2 and a molecular weight of 370.43 g/mol. Its IUPAC name is 4-(2-fluorophenyl)sulfonyl-N-(1,3-thiazol-2-yl)piperazine-1-carboxamide.

Molecular Properties

Compound Name4-(2-fluorophenyl)sulfonyl-N-(1,3-thiazol-2-yl)piperazine-1-carboxamide
PubChem CID134052883
Molecular FormulaC14H15FN4O3S2
Molecular Weight370.43 g/mol
Exact Mass370.06
IUPAC Name4-(2-fluorophenyl)sulfonyl-N-(1,3-thiazol-2-yl)piperazine-1-carboxamide
SMILESO=C(Nc1nccs1)N1CCN(S(=O)(=O)c2ccccc2F)CC1
InChIInChI=1S/C14H15FN4O3S2/c15-11-3-1-2-4-12(11)24(21,22)19-8-6-18(7-9-19)14(20)17-13-16-5-10-23-13/h1-5,10H,6-9H2,(H,16,17,20)
InChIKeyCWCIQFOFZXWKHQ-UHFFFAOYSA-N
XLogP1.82
TPSA82.61 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.43
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-fluoro-3-piperidin-1-ylsulfonyl-N-(1,3-thiazol-2-yl)benzamide
CID 2994136
4-pyridin-2-yl-N-(1,3-thiazol-2-yl)piperazine-1-carboxamide
CID 47148349
N-(1,3-thiazol-2-yl)piperazine-1-carboxamide
CID 127561429
1-(2-methylsulfanylphenyl)sulfonyl-N-(1,3-thiazol-2-yl)piperidine-4-carboxamide
CID 16828269
(2-chloro-4-pyridinyl)-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]methanone
CID 38120168
N-(1-cyclopropylethyl)-4-(2-fluorophenyl)sulfonylpiperazine-1-carboxamide
CID 17449698
1-(2-fluorophenyl)sulfonyl-4-thiophen-2-ylsulfonylpiperazine
CID 51169067
4-(2-fluorophenyl)sulfonyl-N-[(2-imidazol-1-ylphenyl)methyl]piperazine-1-carboxamide
CID 60580721
N-[2-(4-fluorophenyl)ethyl]-4-(2-fluorophenyl)sulfonylpiperazine-1-carboxamide
CID 27532247
(4-chloro-2-pyridinyl)-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]methanone
CID 16560830
2-piperidin-1-ylsulfonyl-N-[4-(1,3-thiazol-2-ylcarbamoyl)phenyl]benzamide
CID 55602026
3-[2-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]-2-oxoethyl]-4-methyl-1,3-thiazol-2-one
CID 9192798

Frequently Asked Questions

What is the IUPAC name of 4-(2-fluorophenyl)sulfonyl-N-(1,3-thiazol-2-yl)piperazine-1-carboxamide?
The IUPAC name of 4-(2-fluorophenyl)sulfonyl-N-(1,3-thiazol-2-yl)piperazine-1-carboxamide (CID 134052883) is 4-(2-fluorophenyl)sulfonyl-N-(1,3-thiazol-2-yl)piperazine-1-carboxamide.
What is the SMILES notation for 4-(2-fluorophenyl)sulfonyl-N-(1,3-thiazol-2-yl)piperazine-1-carboxamide?
The canonical SMILES for 4-(2-fluorophenyl)sulfonyl-N-(1,3-thiazol-2-yl)piperazine-1-carboxamide is O=C(Nc1nccs1)N1CCN(S(=O)(=O)c2ccccc2F)CC1.
What is the InChIKey of 4-(2-fluorophenyl)sulfonyl-N-(1,3-thiazol-2-yl)piperazine-1-carboxamide?
The InChIKey is CWCIQFOFZXWKHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FN4O3S2/c15-11-3-1-2-4-12(11)24(21,22)19-8-6-18(7-9-19)14(20)17-13-16-5-10-23-13/h1-5,10H,6-9H2,(H,16,17,20).
What are the key properties of 4-(2-fluorophenyl)sulfonyl-N-(1,3-thiazol-2-yl)piperazine-1-carboxamide?
4-(2-fluorophenyl)sulfonyl-N-(1,3-thiazol-2-yl)piperazine-1-carboxamide has a molecular weight of 370.43 g/mol, XLogP of 1.82, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-fluorophenyl)sulfonyl-N-(1,3-thiazol-2-yl)piperazine-1-carboxamide is sourced from PubChem (CID 134052883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).